Info
| ID | 5772 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | Ir-H |
| SMILES | Cn1c2ccccc2c2ccnc(-c3ccc(/C=C/C(=O)O)cn3)c21.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
TUCAN
C42H31IrN5O2/(1-45)(2-66)(3-63)(4-51)(5-37)(6-35)(7-36)(8-34)(9-44)(10-64)(11-39)(12-62)(13-48)(14-49)(15-55)(16-50)(17-42)(18-43)(19-46)(20-54)(21-38)(22-62)(23-41)(24-65)(25-56)(26-40)(27-53)(28-52)(29-47)(30-62)(31-80)(32-34)(32-57)(33-52)(33-60)(34-45)(35-51)(35-67)(36-37)(36-57)(37-45)(38-47)(38-60)(39-53)(39-69)(40-43)(40-73)(41-49)(41-58)(42-56)(42-70)(43-59)(44-51)(44-63)(46-53)(46-64)(47-54)(48-55)(48-71)(49-55)(50-61)(50-65)(52-54)(56-59)(57-67)(58-61)(58-71)(59-66)(60-69)(61-68)(62-74)(63-75)(64-76)(65-78)(66-77)(67-75)(68-72)(68-74)(69-76)(70-72)(70-77)(71-74)(72-78)(73-79)(73-80)(75-81)(76-81)(77-81)(78-81)(80-81)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| PC-3 | 32 | 9.2 | 10.1021/acs.inorgchem.4c02583 | 2024 |
| A549 | 35 | 3.3 | 10.1021/acs.inorgchem.4c02583 | 2024 |
| MRC-5 | 39 | 6.5 | 10.1021/acs.inorgchem.4c02583 | 2024 |
🧬 Cell Death Types (1)
Apoptosis
high
«Overall, these results indicated that the photodynamic activity of both the complexes and metallopeptides promotes a regulated cell death by apoptosis.»
Source-assisted 2D generator
Builds the drawing from source ligand graphs and explicit donor metadata, then uses Metal2D only for layout. Publication output uses black bonds without arrows or colour highlighting; validated octahedral enantiomers are encoded directly with solid and hashed wedge bonds.
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